N-butyl-4-[(4-dimethylaminophenyl)methyl]-8-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxamide

Systemtic Name: N-butyl-4-[(4-dimethylaminophenyl)methyl]-8-methoxy-3-oxidanylidene-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxamide Openeye Name: N-butyl-4-[(4-dimethylaminophenyl)methyl]-2-isopropyl-8-methoxy-3-oxo-5H-1,4-benzoxazepine-5-carboxamide CAS Name: N-butyl-4-[(4-dimethylaminophenyl)methyl]-8-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxamide IUPAC Name: N-butyl-4-[(4-dimethylaminophenyl)methyl]-8-methoxy-3-oxo-2-propan-2-yl-5H-1,4-benzoxazepine-5-carboxamide Traditional Name: N-butyl-4-[4-(dimethylamino)benzyl]-2-isopropyl-3-keto-8-methoxy-5H-1,4-benzoxazepine-5-carboxamide Formula: C27H37N3O4 MolecularWeight: 467.60038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1C2=C(C=C(C=C2)OC)OC(C(=O)N1CC3=CC=C(C=C3)N(C)C)C(C)C

Isomeric SMILES

CCCCNC(=O)C1C2=C(C=C(C=C2)OC)OC(C(=O)N1CC3=CC=C(C=C3)N(C)C)C(C)C

InChI

InChI=1S/C27H37N3O4/c1-7-8-15-28-26(31)24-22-14-13-21(33-6)16-23(22)34-25(18(2)3)27(32)30(24)17-19-9-11-20(12-10-19)29(4)5/h9-14,16,18,24-25H,7-8,15,17H2,1-6H3,(H,28,31)