1-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]indol-3-yl]butan-1-one

Systemtic Name: 1-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]indol-3-yl]butan-1-one Openeye Name: 1-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]indol-3-yl]butan-1-one CAS Name: 1-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-3-indolyl]-1-butanone IUPAC Name: 1-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]indol-3-yl]butan-1-one Traditional Name: 1-[1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]indol-3-yl]butan-1-one Formula: C23H24N2O2 MolecularWeight: 360.44886

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCC(=O)C1=CN(C2=CC=CC=C21)CC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H24N2O2/c1-2-7-22(26)20-15-25(21-11-6-5-10-19(20)21)16-23(27)24-13-12-17-8-3-4-9-18(17)14-24/h3-6,8-11,15H,2,7,12-14,16H2,1H3