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

Systemtic Name: ethyl 6-bromanyl-4-[ethyl-(phenylmethyl)amino]quinoline-3-carboxylate Openeye Name: ethyl 4-[benzyl(ethyl)amino]-6-bromo-quinoline-3-carboxylate CAS Name: 6-bromo-4-[ethyl-(phenylmethyl)amino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[benzyl(ethyl)amino]-6-bromoquinoline-3-carboxylate Traditional Name: 4-[benzyl(ethyl)amino]-6-bromo-quinoline-3-carboxylic acid ethyl ester Formula: C21H21BrN2O2 MolecularWeight: 413.30764

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=C3C=C(C=CC3=NC=C2C(=O)OCC)Br

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=C3C=C(C=CC3=NC=C2C(=O)OCC)Br

InChI

InChI=1S/C21H21BrN2O2/c1-3-24(14-15-8-6-5-7-9-15)20-17-12-16(22)10-11-19(17)23-13-18(20)21(25)26-4-2/h5-13H,3-4,14H2,1-2H3