4-(1,3-benzodioxol-4-ylmethyl)-7-chloranyl-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(1,3-benzodioxol-4-ylmethyl)-7-chloranyl-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(1,3-benzodioxol-4-ylmethyl)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(1,3-benzodioxol-4-ylmethyl)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(1,3-benzodioxol-4-ylmethyl)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(1,3-benzodioxol-4-ylmethyl)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C18H18ClNO3 MolecularWeight: 331.79342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(O1)C=CC(=C2)Cl)CC3=C4C(=CC=C3)OCO4

Isomeric SMILES

CC1CN(CC2=C(O1)C=CC(=C2)Cl)CC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C18H18ClNO3/c1-12-8-20(10-14-7-15(19)5-6-16(14)23-12)9-13-3-2-4-17-18(13)22-11-21-17/h2-7,12H,8-11H2,1H3