N-[[3-(3-acetamido-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]-N-(3-azanylpropyl)cyclopropanecarboxamide

Systemtic Name: N-[[3-(3-acetamido-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]-N-(3-azanylpropyl)cyclopropanecarboxamide Openeye Name: N-[[3-(3-acetamido-4-pyrrolidin-1-yl-phenyl)phenyl]methyl]-N-(3-aminopropyl)cyclopropanecarboxamide CAS Name: N-[[3-[3-acetamido-4-(1-pyrrolidinyl)phenyl]phenyl]methyl]-N-(3-aminopropyl)cyclopropanecarboxamide IUPAC Name: N-[[3-(3-acetamido-4-pyrrolidin-1-ylphenyl)phenyl]methyl]-N-(3-aminopropyl)cyclopropanecarboxamide Traditional Name: N-[3-(3-acetamido-4-pyrrolidino-phenyl)benzyl]-N-(3-aminopropyl)cyclopropanecarboxamide Formula: C26H34N4O2 MolecularWeight: 434.57376

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)C2=CC(=CC=C2)CN(CCCN)C(=O)C3CC3)N4CCCC4

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C2=CC(=CC=C2)CN(CCCN)C(=O)C3CC3)N4CCCC4

InChI

InChI=1S/C26H34N4O2/c1-19(31)28-24-17-23(10-11-25(24)29-13-2-3-14-29)22-7-4-6-20(16-22)18-30(15-5-12-27)26(32)21-8-9-21/h4,6-7,10-11,16-17,21H,2-3,5,8-9,12-15,18,27H2,1H3,(H,28,31)