N1-[(2S,3R)-4-(2,3-dihydro-1H-inden-1-ylamino)-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[(2S,3R)-4-(2,3-dihydro-1H-inden-1-ylamino)-3-oxidanyl-1-phenyl-butan-2-yl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[(1S,2R)-1-benzyl-2-hydroxy-3-(indan-1-ylamino)propyl]-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[(2S,3R)-4-(2,3-dihydro-1H-inden-1-ylamino)-3-hydroxy-1-phenylbutan-2-yl]-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[(2S,3R)-4-(2,3-dihydro-1H-inden-1-ylamino)-3-hydroxy-1-phenylbutan-2-yl]-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[(1S,2R)-1-benzyl-2-hydroxy-3-(indan-1-ylamino)propyl]-N',N'-dipropyl-isophthalamide Formula: C33H41N3O3 MolecularWeight: 527.69694

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CNC3CCC4=CC=CC=C34)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC=CC(=C1)C(=O)N[C@@H](CC2=CC=CC=C2)[C@@H](CNC3CCC4=CC=CC=C34)O

InChI

InChI=1S/C33H41N3O3/c1-3-19-36(20-4-2)33(39)27-15-10-14-26(22-27)32(38)35-30(21-24-11-6-5-7-12-24)31(37)23-34-29-18-17-25-13-8-9-16-28(25)29/h5-16,22,29-31,34,37H,3-4,17-21,23H2,1-2H3,(H,35,38)/t29?,30-,31+/m0/s1