3-[3-[4-(phenylmethyl)piperazin-1-yl]propylamino]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione

Systemtic Name: 3-[3-[4-(phenylmethyl)piperazin-1-yl]propylamino]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione Openeye Name: 3-[3-(4-benzylpiperazin-1-yl)propylamino]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione CAS Name: 3-[3-[4-(phenylmethyl)-1-piperazinyl]propylamino]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[3-(4-benzylpiperazin-1-yl)propylamino]-1-(4-propoxyphenyl)pyrrolidine-2,5-dione Traditional Name: 3-[3-(4-benzylpiperazino)propylamino]-1-(4-propoxyphenyl)pyrrolidine-2,5-quinone Formula: C27H36N4O3 MolecularWeight: 464.59974

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)NCCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O3/c1-2-19-34-24-11-9-23(10-12-24)31-26(32)20-25(27(31)33)28-13-6-14-29-15-17-30(18-16-29)21-22-7-4-3-5-8-22/h3-5,7-12,25,28H,2,6,13-21H2,1H3