3-methoxy-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4-prop-2-enoxy-benzamide

Systemtic Name: 3-methoxy-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4-prop-2-enoxy-benzamide Openeye Name: 4-allyloxy-N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-methoxy-benzamide CAS Name: 3-methoxy-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-4-prop-2-enoxybenzamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-methoxy-4-prop-2-enoxybenzamide Traditional Name: 4-allyloxy-N-[4-(4-benzylpiperazino)phenyl]-3-methoxy-benzamide Formula: C28H31N3O3 MolecularWeight: 457.56404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)CC4=CC=CC=C4)OCC=C

InChI

InChI=1S/C28H31N3O3/c1-3-19-34-26-14-9-23(20-27(26)33-2)28(32)29-24-10-12-25(13-11-24)31-17-15-30(16-18-31)21-22-7-5-4-6-8-22/h3-14,20H,1,15-19,21H2,2H3,(H,29,32)