(1S,2R)-1,2-bis(3,4-dimethoxyphenyl)-N-(phenylmethyl)butan-1-amine

Systemtic Name: (1S,2R)-1,2-bis(3,4-dimethoxyphenyl)-N-(phenylmethyl)butan-1-amine Openeye Name: (1S,2R)-N-benzyl-1,2-bis(3,4-dimethoxyphenyl)butan-1-amine CAS Name: (1S,2R)-1,2-bis(3,4-dimethoxyphenyl)-N-(phenylmethyl)-1-butanamine IUPAC Name: (1S,2R)-N-benzyl-1,2-bis(3,4-dimethoxyphenyl)butan-1-amine Traditional Name: benzyl-[(1S,2R)-1,2-bis(3,4-dimethoxyphenyl)butyl]amine Formula: C27H33NO4 MolecularWeight: 435.55522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)OC)OC)C(C2=CC(=C(C=C2)OC)OC)NCC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C1=CC(=C(C=C1)OC)OC)[C@@H](C2=CC(=C(C=C2)OC)OC)NCC3=CC=CC=C3

InChI

InChI=1S/C27H33NO4/c1-6-22(20-12-14-23(29-2)25(16-20)31-4)27(28-18-19-10-8-7-9-11-19)21-13-15-24(30-3)26(17-21)32-5/h7-17,22,27-28H,6,18H2,1-5H3/t22-,27-/m1/s1