methyl 6-[(4-azanylcyclohexyl)carbamoyl]-2-butan-2-yl-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxylate

Systemtic Name: methyl 6-[(4-azanylcyclohexyl)carbamoyl]-2-butan-2-yl-3-oxidanylidene-2,4-dihydroquinoxaline-1-carboxylate Openeye Name: methyl 6-[(4-aminocyclohexyl)carbamoyl]-3-oxo-2-sec-butyl-2,4-dihydroquinoxaline-1-carboxylate CAS Name: 6-[[(4-aminocyclohexyl)amino]-oxomethyl]-2-butan-2-yl-3-oxo-2,4-dihydroquinoxaline-1-carboxylic acid methyl ester IUPAC Name: methyl 6-[(4-aminocyclohexyl)carbamoyl]-2-butan-2-yl-3-oxo-2,4-dihydroquinoxaline-1-carboxylate Traditional Name: 6-[(4-aminocyclohexyl)carbamoyl]-3-keto-2-sec-butyl-2,4-dihydroquinoxaline-1-carboxylic acid methyl ester Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)NC2=C(N1C(=O)OC)C=CC(=C2)C(=O)NC3CCC(CC3)N

Isomeric SMILES

CCC(C)C1C(=O)NC2=C(N1C(=O)OC)C=CC(=C2)C(=O)NC3CCC(CC3)N

InChI

InChI=1S/C21H30N4O4/c1-4-12(2)18-20(27)24-16-11-13(5-10-17(16)25(18)21(28)29-3)19(26)23-15-8-6-14(22)7-9-15/h5,10-12,14-15,18H,4,6-9,22H2,1-3H3,(H,23,26)(H,24,27)