N-[(2S,4S,5S,7S)-4-azanyl-7-(butylcarbamoyl)-8-methyl-5-oxidanyl-2-propan-2-yl-nonyl]-2-(4-methoxybutoxy)-N-methyl-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[(2S,4S,5S,7S)-4-azanyl-7-(butylcarbamoyl)-8-methyl-5-oxidanyl-2-propan-2-yl-nonyl]-2-(4-methoxybutoxy)-N-methyl-4-pyrrolidin-1-yl-benzamide Openeye Name: N-[(2S,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-2-isopropyl-8-methyl-nonyl]-2-(4-methoxybutoxy)-N-methyl-4-pyrrolidin-1-yl-benzamide CAS Name: N-[(2S,4S,5S,7S)-4-amino-7-[butylamino(oxo)methyl]-5-hydroxy-8-methyl-2-propan-2-ylnonyl]-2-(4-methoxybutoxy)-N-methyl-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-[(2S,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-8-methyl-2-propan-2-ylnonyl]-2-(4-methoxybutoxy)-N-methyl-4-pyrrolidin-1-ylbenzamide Traditional Name: N-[(2S,4S,5S,7S)-4-amino-7-(butylcarbamoyl)-5-hydroxy-2-isopropyl-8-methyl-nonyl]-2-(4-methoxybutoxy)-N-methyl-4-pyrrolidino-benzamide Formula: C35H62N4O5 MolecularWeight: 618.89058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC(C(CC(CN(C)C(=O)C1=C(C=C(C=C1)N2CCCC2)OCCCCOC)C(C)C)N)O)C(C)C

Isomeric SMILES

CCCCNC(=O)[C@@H](C[C@@H]([C@H](C[C@H](CN(C)C(=O)C1=C(C=C(C=C1)N2CCCC2)OCCCCOC)C(C)C)N)O)C(C)C

InChI

InChI=1S/C35H62N4O5/c1-8-9-16-37-34(41)30(26(4)5)23-32(40)31(36)21-27(25(2)3)24-38(6)35(42)29-15-14-28(39-17-10-11-18-39)22-33(29)44-20-13-12-19-43-7/h14-15,22,25-27,30-32,40H,8-13,16-21,23-24,36H2,1-7H3,(H,37,41)/t27-,30+,31+,32+/m1/s1