3,3-dimethyl-1-[3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]indol-1-yl]pent-4-yn-1-one

Systemtic Name: 3,3-dimethyl-1-[3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]indol-1-yl]pent-4-yn-1-one Openeye Name: 1-[3-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)indol-1-yl]-3,3-dimethyl-pent-4-yn-1-one CAS Name: 3,3-dimethyl-1-[3-[1-(phenylmethyl)-3,6-dihydro-2H-pyridin-5-yl]-1-indolyl]-4-pentyn-1-one IUPAC Name: 1-[3-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)indol-1-yl]-3,3-dimethylpent-4-yn-1-one Traditional Name: 1-[3-(1-benzyl-3,6-dihydro-2H-pyridin-5-yl)indol-1-yl]-3,3-dimethyl-pent-4-yn-1-one Formula: C27H28N2O MolecularWeight: 396.52402

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)N1C=C(C2=CC=CC=C21)C3=CCCN(C3)CC4=CC=CC=C4)C#C

Isomeric SMILES

CC(C)(CC(=O)N1C=C(C2=CC=CC=C21)C3=CCCN(C3)CC4=CC=CC=C4)C#C

InChI

InChI=1S/C27H28N2O/c1-4-27(2,3)17-26(30)29-20-24(23-14-8-9-15-25(23)29)22-13-10-16-28(19-22)18-21-11-6-5-7-12-21/h1,5-9,11-15,20H,10,16-19H2,2-3H3