(3-phenylmethoxycarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-(phenylmethyl)carbamic acid

Systemtic Name: (3-phenylmethoxycarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-(phenylmethyl)carbamic acid Openeye Name: benzyl-(3-benzyloxycarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamic acid CAS Name: (3-phenylmethoxycarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-(phenylmethyl)carbamic acid IUPAC Name: benzyl-(3-phenylmethoxycarbonyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamic acid Traditional Name: benzyl-(3-carbobenzoxy-1,2,4,5-tetrahydro-3-benzazepin-7-yl)carbamic acid Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC2=C1C=CC(=C2)N(CC3=CC=CC=C3)C(=O)O)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC2=C1C=CC(=C2)N(CC3=CC=CC=C3)C(=O)O)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26N2O4/c29-25(30)28(18-20-7-3-1-4-8-20)24-12-11-22-13-15-27(16-14-23(22)17-24)26(31)32-19-21-9-5-2-6-10-21/h1-12,17H,13-16,18-19H2,(H,29,30)