N-(3-azanylpropyl)-N-[[3-(3-cyclopentylpropanoylamino)phenyl]methyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[[3-(3-cyclopentylpropanoylamino)phenyl]methyl]-3,4-dimethoxy-benzamide Openeye Name: N-(3-aminopropyl)-N-[[3-(3-cyclopentylpropanoylamino)phenyl]methyl]-3,4-dimethoxy-benzamide CAS Name: N-(3-aminopropyl)-N-[[3-[(3-cyclopentyl-1-oxopropyl)amino]phenyl]methyl]-3,4-dimethoxybenzamide IUPAC Name: N-(3-aminopropyl)-N-[[3-(3-cyclopentylpropanoylamino)phenyl]methyl]-3,4-dimethoxybenzamide Traditional Name: N-(3-aminopropyl)-N-[3-(3-cyclopentylpropanoylamino)benzyl]-3,4-dimethoxy-benzamide Formula: C27H37N3O4 MolecularWeight: 467.60038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)CCC3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)CCC3CCCC3)OC

InChI

InChI=1S/C27H37N3O4/c1-33-24-13-12-22(18-25(24)34-2)27(32)30(16-6-15-28)19-21-9-5-10-23(17-21)29-26(31)14-11-20-7-3-4-8-20/h5,9-10,12-13,17-18,20H,3-4,6-8,11,14-16,19,28H2,1-2H3,(H,29,31)