4-(diphenylmethyl)-1-ethyl-3-piperazin-1-yl-quinolin-2-one

Systemtic Name: 4-(diphenylmethyl)-1-ethyl-3-piperazin-1-yl-quinolin-2-one Openeye Name: 4-benzhydryl-1-ethyl-3-piperazin-1-yl-quinolin-2-one CAS Name: 4-(diphenylmethyl)-1-ethyl-3-(1-piperazinyl)-2-quinolinone IUPAC Name: 4-benzhydryl-1-ethyl-3-piperazin-1-ylquinolin-2-one Traditional Name: 4-benzhydryl-1-ethyl-3-piperazino-carbostyril Formula: C28H29N3O MolecularWeight: 423.54936

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=C(C1=O)N3CCNCC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCN1C2=CC=CC=C2C(=C(C1=O)N3CCNCC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O/c1-2-31-24-16-10-9-15-23(24)26(27(28(31)32)30-19-17-29-18-20-30)25(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,25,29H,2,17-20H2,1H3