ethyl 1-butyl-2-[[4-(dimethylaminomethyl)phenyl]carbonylamino]pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 1-butyl-2-[[4-(dimethylaminomethyl)phenyl]carbonylamino]pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 1-butyl-2-[[4-(dimethylaminomethyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 1-butyl-2-[[[4-(dimethylaminomethyl)phenyl]-oxomethyl]amino]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-butyl-2-[[4-(dimethylaminomethyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 1-butyl-2-[[4-(dimethylaminomethyl)benzoyl]amino]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)C4=CC=C(C=C4)CN(C)C

Isomeric SMILES

CCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)C(=O)OCC)NC(=O)C4=CC=C(C=C4)CN(C)C

InChI

InChI=1S/C27H31N5O3/c1-5-7-16-32-24(30-26(33)19-14-12-18(13-15-19)17-31(3)4)22(27(34)35-6-2)23-25(32)29-21-11-9-8-10-20(21)28-23/h8-15H,5-7,16-17H2,1-4H3,(H,30,33)