ethyl 6-(methylcarbamoyl)-4-[(phenylmethyl)amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-(methylcarbamoyl)-4-[(phenylmethyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 4-(benzylamino)-6-(methylcarbamoyl)quinoline-3-carboxylate CAS Name: 6-(methylcarbamoyl)-4-[(phenylmethyl)amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(benzylamino)-6-(methylcarbamoyl)quinoline-3-carboxylate Traditional Name: 4-(benzylamino)-6-(methylcarbamoyl)quinoline-3-carboxylic acid ethyl ester Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC3=CC=CC=C3)C(=O)NC

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NCC3=CC=CC=C3)C(=O)NC

InChI

InChI=1S/C21H21N3O3/c1-3-27-21(26)17-13-23-18-10-9-15(20(25)22-2)11-16(18)19(17)24-12-14-7-5-4-6-8-14/h4-11,13H,3,12H2,1-2H3,(H,22,25)(H,23,24)