methyl 4-[[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]anilino]-4-oxo-butanoate CAS Name: 4-[3-methoxy-4-[3-(4-phenyl-1-piperazinyl)propoxy]anilino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[3-methoxy-4-[3-(4-phenylpiperazin-1-yl)propoxy]anilino]-4-oxobutanoate Traditional Name: 4-keto-4-[3-methoxy-4-[3-(4-phenylpiperazino)propoxy]anilino]butyric acid methyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)CCC(=O)OC)OCCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)CCC(=O)OC)OCCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O5/c1-31-23-19-20(26-24(29)11-12-25(30)32-2)9-10-22(23)33-18-6-13-27-14-16-28(17-15-27)21-7-4-3-5-8-21/h3-5,7-10,19H,6,11-18H2,1-2H3,(H,26,29)