N-[4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-4-(phenylsulfonyl)-2-propoxy-butanamide hydrochloride

Systemtic Name: N-[4-[(3-methoxyphenyl)methylamino]-3-oxidanyl-1-phenyl-butan-2-yl]-4-(phenylsulfonyl)-2-propoxy-butanamide hydrochloride Openeye Name: 4-(benzenesulfonyl)-N-[1-benzyl-2-hydroxy-3-[(3-methoxyphenyl)methylamino]propyl]-2-propoxy-butanamide hydrochloride CAS Name: 4-(benzenesulfonyl)-N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-2-propoxybutanamide hydrochloride IUPAC Name: 4-(benzenesulfonyl)-N-[3-hydroxy-4-[(3-methoxyphenyl)methylamino]-1-phenylbutan-2-yl]-2-propoxybutanamide hydrochloride Traditional Name: N-[1-benzyl-2-hydroxy-3-(m-anisylamino)propyl]-4-besyl-2-propoxy-butyramide hydrochloride Formula: C31H41ClN2O6S MolecularWeight: 605.18504

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(CCS(=O)(=O)C1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(CNCC3=CC(=CC=C3)OC)O.Cl

Isomeric SMILES

CCCOC(CCS(=O)(=O)C1=CC=CC=C1)C(=O)NC(CC2=CC=CC=C2)C(CNCC3=CC(=CC=C3)OC)O.Cl

InChI

InChI=1S/C31H40N2O6S.ClH/c1-3-18-39-30(17-19-40(36,37)27-15-8-5-9-16-27)31(35)33-28(21-24-11-6-4-7-12-24)29(34)23-32-22-25-13-10-14-26(20-25)38-2;/h4-16,20,28-30,32,34H,3,17-19,21-23H2,1-2H3,(H,33,35);1H