tert-butyl 2-[3-[(4-methylphenyl)carbamoylamino]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[3-[(4-methylphenyl)carbamoylamino]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]ethanoate Openeye Name: tert-butyl 2-[3-(p-tolylcarbamoylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]acetate CAS Name: 2-[3-[[(4-methylanilino)-oxomethyl]amino]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[(4-methylphenyl)carbamoylamino]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]acetate Traditional Name: 2-[3-(p-tolylcarbamoylamino)-2,3,4,5-tetrahydro-1-benzazepin-1-yl]acetic acid tert-butyl ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2CCC3=CC=CC=C3N(C2)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2CCC3=CC=CC=C3N(C2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C24H31N3O3/c1-17-9-12-19(13-10-17)25-23(29)26-20-14-11-18-7-5-6-8-21(18)27(15-20)16-22(28)30-24(2,3)4/h5-10,12-13,20H,11,14-16H2,1-4H3,(H2,25,26,29)