tert-butyl 4-[(8-methyl-4-oxidanylidene-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(8-methyl-4-oxidanylidene-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(8-methyl-4-oxo-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylate CAS Name: 4-[[(8-methyl-4-oxo-1H-quinolin-3-yl)amino]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(8-methyl-4-oxo-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(4-keto-8-methyl-1H-quinolin-3-yl)carbamoyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C20H26N4O4 MolecularWeight: 386.44484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC=C(C2=O)NC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1NC=C(C2=O)NC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H26N4O4/c1-13-6-5-7-14-16(13)21-12-15(17(14)25)22-18(26)23-8-10-24(11-9-23)19(27)28-20(2,3)4/h5-7,12H,8-11H2,1-4H3,(H,21,25)(H,22,26)