3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methoxy-4-methyl-phenyl)methanamine

Systemtic Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methoxy-4-methyl-phenyl)methanamine Openeye Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methoxy-4-methyl-phenyl)methanamine CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methoxy-4-methylphenyl)methanamine IUPAC Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methoxy-4-methylphenyl)methanamine Traditional Name: [3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(3-methoxy-4-methyl-phenyl)methyl]amine Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C2=CC3=C(C=C2)OCCCO3)N)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(C2=CC3=C(C=C2)OCCCO3)N)OC

InChI

InChI=1S/C18H21NO3/c1-12-4-5-13(10-16(12)20-2)18(19)14-6-7-15-17(11-14)22-9-3-8-21-15/h4-7,10-11,18H,3,8-9,19H2,1-2H3