2-piperidin-1-yl-4-[(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)methylidene]cyclobutane-1,3-dione

Systemtic Name: 2-piperidin-1-yl-4-[(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)methylidene]cyclobutane-1,3-dione Openeye Name: 2-(1-piperidyl)-4-[(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)methylene]cyclobutane-1,3-dione CAS Name: 2-(1-piperidinyl)-4-[(1,1,3-trimethyl-2-benzo[e]indol-3-iumyl)methylidene]cyclobutane-1,3-dione IUPAC Name: 2-piperidin-1-yl-4-[(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)methylidene]cyclobutane-1,3-dione Traditional Name: 2-piperidino-4-[(1,1,3-trimethylbenz[e]indol-3-ium-2-yl)methylene]cyclobutane-1,3-quinone Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=C4C(=O)C(C4=O)N5CCCCC5)C

Isomeric SMILES

CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=C4C(=O)C(C4=O)N5CCCCC5)C

InChI

InChI=1S/C25H27N2O2/c1-25(2)20(15-18-23(28)22(24(18)29)27-13-7-4-8-14-27)26(3)19-12-11-16-9-5-6-10-17(16)21(19)25/h5-6,9-12,15,22H,4,7-8,13-14H2,1-3H3/q+1