N-[(3-methylphenyl)methyl]-3-(4-phenyl-3,4-dihydro-1H-isochromen-1-yl)propan-1-amine

Systemtic Name: N-[(3-methylphenyl)methyl]-3-(4-phenyl-3,4-dihydro-1H-isochromen-1-yl)propan-1-amine Openeye Name: N-(m-tolylmethyl)-3-(4-phenylisochroman-1-yl)propan-1-amine CAS Name: N-[(3-methylphenyl)methyl]-3-(4-phenyl-3,4-dihydro-1H-2-benzopyran-1-yl)-1-propanamine IUPAC Name: N-[(3-methylphenyl)methyl]-3-(4-phenyl-3,4-dihydro-1H-isochromen-1-yl)propan-1-amine Traditional Name: (3-methylbenzyl)-[3-(4-phenylisochroman-1-yl)propyl]amine Formula: C26H29NO MolecularWeight: 371.51456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNCCCC2C3=CC=CC=C3C(CO2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CNCCCC2C3=CC=CC=C3C(CO2)C4=CC=CC=C4

InChI

InChI=1S/C26H29NO/c1-20-9-7-10-21(17-20)18-27-16-8-15-26-24-14-6-5-13-23(24)25(19-28-26)22-11-3-2-4-12-22/h2-7,9-14,17,25-27H,8,15-16,18-19H2,1H3