(2S)-4-[(3-ethoxy-4-methoxy-phenyl)methyl]-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: (2S)-4-[(3-ethoxy-4-methoxy-phenyl)methyl]-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: (2S)-4-[(3-ethoxy-4-methoxy-phenyl)methyl]-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: (2S)-4-[(3-ethoxy-4-methoxyphenyl)methyl]-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: (2S)-4-[(3-ethoxy-4-methoxyphenyl)methyl]-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: (2S)-4-(3-ethoxy-4-methoxy-benzyl)-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CC(OC3=CC=CC=C3C2)C)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2C[C@@H](OC3=CC=CC=C3C2)C)OC

InChI

InChI=1S/C20H25NO3/c1-4-23-20-11-16(9-10-19(20)22-3)13-21-12-15(2)24-18-8-6-5-7-17(18)14-21/h5-11,15H,4,12-14H2,1-3H3/t15-/m0/s1