[4-[5-(aminomethyl)-2-phenylmethoxy-phenyl]-3,6-dihydro-2H-pyridin-1-yl]-(2-ethylpyridin-3-yl)methanone

Systemtic Name: [4-[5-(aminomethyl)-2-phenylmethoxy-phenyl]-3,6-dihydro-2H-pyridin-1-yl]-(2-ethylpyridin-3-yl)methanone Openeye Name: [4-[5-(aminomethyl)-2-benzyloxy-phenyl]-3,6-dihydro-2H-pyridin-1-yl]-(2-ethyl-3-pyridyl)methanone CAS Name: [4-[5-(aminomethyl)-2-phenylmethoxyphenyl]-3,6-dihydro-2H-pyridin-1-yl]-(2-ethyl-3-pyridinyl)methanone IUPAC Name: [4-[5-(aminomethyl)-2-phenylmethoxyphenyl]-3,6-dihydro-2H-pyridin-1-yl]-(2-ethylpyridin-3-yl)methanone Traditional Name: [4-[5-(aminomethyl)-2-benzoxy-phenyl]-3,6-dihydro-2H-pyridin-1-yl]-(2-ethyl-3-pyridyl)methanone Formula: C27H29N3O2 MolecularWeight: 427.53806

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=N1)C(=O)N2CCC(=CC2)C3=C(C=CC(=C3)CN)OCC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C=CC=N1)C(=O)N2CCC(=CC2)C3=C(C=CC(=C3)CN)OCC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2/c1-2-25-23(9-6-14-29-25)27(31)30-15-12-22(13-16-30)24-17-21(18-28)10-11-26(24)32-19-20-7-4-3-5-8-20/h3-12,14,17H,2,13,15-16,18-19,28H2,1H3