(E)-1-[3-(1-butylindol-3-yl)pyrrolidin-1-yl]-3-(2-chlorophenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[3-(1-butylindol-3-yl)pyrrolidin-1-yl]-3-(2-chlorophenyl)prop-2-en-1-one Openeye Name: (E)-1-[3-(1-butylindol-3-yl)pyrrolidin-1-yl]-3-(2-chlorophenyl)prop-2-en-1-one CAS Name: (E)-1-[3-(1-butyl-3-indolyl)-1-pyrrolidinyl]-3-(2-chlorophenyl)-2-propen-1-one IUPAC Name: (E)-1-[3-(1-butylindol-3-yl)pyrrolidin-1-yl]-3-(2-chlorophenyl)prop-2-en-1-one Traditional Name: (E)-1-[3-(1-butylindol-3-yl)pyrrolidino]-3-(2-chlorophenyl)prop-2-en-1-one Formula: C25H27ClN2O MolecularWeight: 406.94768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=CC=CC=C21)C3CCN(C3)C(=O)C=CC4=CC=CC=C4Cl

Isomeric SMILES

CCCCN1C=C(C2=CC=CC=C21)C3CCN(C3)C(=O)/C=C/C4=CC=CC=C4Cl

InChI

InChI=1S/C25H27ClN2O/c1-2-3-15-27-18-22(21-9-5-7-11-24(21)27)20-14-16-28(17-20)25(29)13-12-19-8-4-6-10-23(19)26/h4-13,18,20H,2-3,14-17H2,1H3/b13-12+