methyl 2-methoxy-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylmethyl)benzoate

Systemtic Name: methyl 2-methoxy-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylmethyl)benzoate Openeye Name: methyl 2-methoxy-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylmethyl)benzoate CAS Name: 2-methoxy-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylmethyl)benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylmethyl)benzoate Traditional Name: 2-methoxy-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylmethyl)benzoic acid methyl ester Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCCCC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCCCC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C20H23NO3/c1-23-19-13-15(10-11-17(19)20(22)24-2)14-21-12-6-5-8-16-7-3-4-9-18(16)21/h3-4,7,9-11,13H,5-6,8,12,14H2,1-2H3