ethyl 1-methyl-6-(phenylmethyl)-4,5,7,8-tetrahydropyrrolo[2,3-d]azepine-2-carboxylate

Systemtic Name: ethyl 1-methyl-6-(phenylmethyl)-4,5,7,8-tetrahydropyrrolo[2,3-d]azepine-2-carboxylate Openeye Name: ethyl 6-benzyl-1-methyl-4,5,7,8-tetrahydropyrrolo[2,3-d]azepine-2-carboxylate CAS Name: 1-methyl-6-(phenylmethyl)-4,5,7,8-tetrahydropyrrolo[2,3-d]azepine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-benzyl-1-methyl-4,5,7,8-tetrahydropyrrolo[2,3-d]azepine-2-carboxylate Traditional Name: 6-benzyl-1-methyl-4,5,7,8-tetrahydropyrrol[2,3-d]azepine-2-carboxylic acid ethyl ester Formula: C19H24N2O2 MolecularWeight: 312.40606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1C)CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1C)CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O2/c1-3-23-19(22)18-13-16-9-11-21(12-10-17(16)20(18)2)14-15-7-5-4-6-8-15/h4-8,13H,3,9-12,14H2,1-2H3