3-[1-(3-azanylpropyl)-2-(4-chlorophenyl)indol-3-yl]-1,6-dimethyl-quinoxalin-2-one

Systemtic Name: 3-[1-(3-azanylpropyl)-2-(4-chlorophenyl)indol-3-yl]-1,6-dimethyl-quinoxalin-2-one Openeye Name: 3-[1-(3-aminopropyl)-2-(4-chlorophenyl)indol-3-yl]-1,6-dimethyl-quinoxalin-2-one CAS Name: 3-[1-(3-aminopropyl)-2-(4-chlorophenyl)-3-indolyl]-1,6-dimethyl-2-quinoxalinone IUPAC Name: 3-[1-(3-aminopropyl)-2-(4-chlorophenyl)indol-3-yl]-1,6-dimethylquinoxalin-2-one Traditional Name: 3-[1-(3-aminopropyl)-2-(4-chlorophenyl)indol-3-yl]-1,6-dimethyl-quinoxalin-2-one Formula: C27H25ClN4O MolecularWeight: 456.9666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C(=N2)C3=C(N(C4=CC=CC=C43)CCCN)C5=CC=C(C=C5)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C(=N2)C3=C(N(C4=CC=CC=C43)CCCN)C5=CC=C(C=C5)Cl)C

InChI

InChI=1S/C27H25ClN4O/c1-17-8-13-23-21(16-17)30-25(27(33)31(23)2)24-20-6-3-4-7-22(20)32(15-5-14-29)26(24)18-9-11-19(28)12-10-18/h3-4,6-13,16H,5,14-15,29H2,1-2H3