N-(3-ethanoylphenyl)-4-oxidanylidene-3,4-bis[4-(phenylmethyl)piperazin-1-yl]butanamide

Systemtic Name: N-(3-ethanoylphenyl)-4-oxidanylidene-3,4-bis[4-(phenylmethyl)piperazin-1-yl]butanamide Openeye Name: N-(3-acetylphenyl)-3,4-bis(4-benzylpiperazin-1-yl)-4-oxo-butanamide CAS Name: N-(3-acetylphenyl)-4-oxo-3,4-bis[4-(phenylmethyl)-1-piperazinyl]butanamide IUPAC Name: N-(3-acetylphenyl)-3,4-bis(4-benzylpiperazin-1-yl)-4-oxobutanamide Traditional Name: N-(3-acetylphenyl)-3,4-bis(4-benzylpiperazino)-4-keto-butyramide Formula: C34H41N5O3 MolecularWeight: 567.72104

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CC(C(=O)N2CCN(CC2)CC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CC(C(=O)N2CCN(CC2)CC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C34H41N5O3/c1-27(40)30-13-8-14-31(23-30)35-33(41)24-32(38-19-15-36(16-20-38)25-28-9-4-2-5-10-28)34(42)39-21-17-37(18-22-39)26-29-11-6-3-7-12-29/h2-14,23,32H,15-22,24-26H2,1H3,(H,35,41)