ethyl 2-[8-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl]ethanoate

Systemtic Name: ethyl 2-[8-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl]ethanoate Openeye Name: ethyl 2-[8-(benzyloxycarbonylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl]acetate CAS Name: 2-[8-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[8-(phenylmethoxycarbonylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl]acetate Traditional Name: 2-[8-(benzyloxycarbonylamino)-2,3,4,5-tetrahydro-1H-1-benzazepin-2-yl]acetic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCCC2=C(N1)C=C(C=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC1CCCC2=C(N1)C=C(C=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O4/c1-2-27-21(25)14-18-10-6-9-17-11-12-19(13-20(17)23-18)24-22(26)28-15-16-7-4-3-5-8-16/h3-5,7-8,11-13,18,23H,2,6,9-10,14-15H2,1H3,(H,24,26)