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

Systemtic Name: N-[[3-(3-acetamido-4-morpholin-4-yl-phenyl)phenyl]methyl]-N-(3-azanylpropyl)cyclopropanecarboxamide Openeye Name: N-[[3-(3-acetamido-4-morpholino-phenyl)phenyl]methyl]-N-(3-aminopropyl)cyclopropanecarboxamide CAS Name: N-[[3-[3-acetamido-4-(4-morpholinyl)phenyl]phenyl]methyl]-N-(3-aminopropyl)cyclopropanecarboxamide IUPAC Name: N-[[3-(3-acetamido-4-morpholin-4-ylphenyl)phenyl]methyl]-N-(3-aminopropyl)cyclopropanecarboxamide Traditional Name: N-[3-(3-acetamido-4-morpholino-phenyl)benzyl]-N-(3-aminopropyl)cyclopropanecarboxamide Formula: C26H34N4O3 MolecularWeight: 450.57316

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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)N4CCOCC4

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)C2=CC(=CC=C2)CN(CCCN)C(=O)C3CC3)N4CCOCC4

InChI

InChI=1S/C26H34N4O3/c1-19(31)28-24-17-23(8-9-25(24)29-12-14-33-15-13-29)22-5-2-4-20(16-22)18-30(11-3-10-27)26(32)21-6-7-21/h2,4-5,8-9,16-17,21H,3,6-7,10-15,18,27H2,1H3,(H,28,31)