(7-chloranyl-1-phenyl-4,5-dihydrobenzo[g]indazol-3-yl)carbonyl-(2-diethylaminoethyl)-methyl-azanium

Systemtic Name: (7-chloranyl-1-phenyl-4,5-dihydrobenzo[g]indazol-3-yl)carbonyl-(2-diethylaminoethyl)-methyl-azanium Openeye Name: (7-chloro-1-phenyl-4,5-dihydrobenzo[g]indazole-3-carbonyl)-(2-diethylaminoethyl)-methyl-ammonium CAS Name: [(7-chloro-1-phenyl-4,5-dihydrobenzo[g]indazol-3-yl)-oxomethyl]-(2-diethylaminoethyl)-methylammonium IUPAC Name: (7-chloro-1-phenyl-4,5-dihydrobenzo[g]indazole-3-carbonyl)-(2-diethylaminoethyl)-methylazanium Traditional Name: (7-chloro-1-phenyl-4,5-dihydrobenz[g]indazole-3-carbonyl)-(2-diethylaminoethyl)-methyl-ammonium Formula: C25H30ClN4O+ MolecularWeight: 437.9849

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[NH+](C)C(=O)C1=NN(C2=C1CCC3=C2C=CC(=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCN(CC)CC[NH+](C)C(=O)C1=NN(C2=C1CCC3=C2C=CC(=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H29ClN4O/c1-4-29(5-2)16-15-28(3)25(31)23-22-13-11-18-17-19(26)12-14-21(18)24(22)30(27-23)20-9-7-6-8-10-20/h6-10,12,14,17H,4-5,11,13,15-16H2,1-3H3/p+1