N-[(7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzoxepin-1-yl)methyl]adamantan-1-amine

Systemtic Name: N-[(7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzoxepin-1-yl)methyl]adamantan-1-amine Openeye Name: N-[(7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzoxepin-1-yl)methyl]adamantan-1-amine CAS Name: N-[(7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzoxepin-1-yl)methyl]-1-adamantanamine IUPAC Name: N-[(7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzoxepin-1-yl)methyl]adamantan-1-amine Traditional Name: 1-adamantyl-[(7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzoxepin-1-yl)methyl]amine Formula: C23H33NO3 MolecularWeight: 371.51302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(OCCCC2=C1)CNC34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=C(C=C2C(OCCCC2=C1)CNC34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C23H33NO3/c1-25-20-9-18-4-3-5-27-22(19(18)10-21(20)26-2)14-24-23-11-15-6-16(12-23)8-17(7-15)13-23/h9-10,15-17,22,24H,3-8,11-14H2,1-2H3