N-[2-[4-(4-butylphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-4-methoxy-quinoline-2-carboxamide

Systemtic Name: N-[2-[4-(4-butylphenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-4-methoxy-quinoline-2-carboxamide Openeye Name: N-[2-[4-(4-butylbenzoyl)piperazin-1-yl]-2-oxo-ethyl]-4-methoxy-quinoline-2-carboxamide CAS Name: N-[2-[4-[(4-butylphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-4-methoxy-2-quinolinecarboxamide IUPAC Name: N-[2-[4-(4-butylbenzoyl)piperazin-1-yl]-2-oxoethyl]-4-methoxyquinoline-2-carboxamide Traditional Name: N-[2-[4-(4-butylbenzoyl)piperazino]-2-keto-ethyl]-4-methoxy-quinaldamide Formula: C28H32N4O4 MolecularWeight: 488.57808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CNC(=O)C3=NC4=CC=CC=C4C(=C3)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CNC(=O)C3=NC4=CC=CC=C4C(=C3)OC

InChI

InChI=1S/C28H32N4O4/c1-3-4-7-20-10-12-21(13-11-20)28(35)32-16-14-31(15-17-32)26(33)19-29-27(34)24-18-25(36-2)22-8-5-6-9-23(22)30-24/h5-6,8-13,18H,3-4,7,14-17,19H2,1-2H3,(H,29,34)