[5-(aminomethyl)-7-phenyl-1-(phenylcarbonyloxy)-7,8-dihydronaphthalen-2-yl] benzoate hydrochloride

Systemtic Name: [5-(aminomethyl)-7-phenyl-1-(phenylcarbonyloxy)-7,8-dihydronaphthalen-2-yl] benzoate hydrochloride Openeye Name: [5-(aminomethyl)-1-benzoyloxy-7-phenyl-7,8-dihydronaphthalen-2-yl] benzoate hydrochloride CAS Name: benzoic acid [5-(aminomethyl)-1-benzoyloxy-7-phenyl-7,8-dihydronaphthalen-2-yl] ester hydrochloride IUPAC Name: [5-(aminomethyl)-1-benzoyloxy-7-phenyl-7,8-dihydronaphthalen-2-yl] benzoate hydrochloride Traditional Name: benzoic acid [5-(aminomethyl)-1-benzoyloxy-7-phenyl-7,8-dihydronaphthalen-2-yl] ester hydrochloride Formula: C31H26ClNO4 MolecularWeight: 511.99544

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=C(C2=C1C(=C(C=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)CN)C5=CC=CC=C5.Cl

Isomeric SMILES

C1C(C=C(C2=C1C(=C(C=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4)CN)C5=CC=CC=C5.Cl

InChI

InChI=1S/C31H25NO4.ClH/c32-20-25-18-24(21-10-4-1-5-11-21)19-27-26(25)16-17-28(35-30(33)22-12-6-2-7-13-22)29(27)36-31(34)23-14-8-3-9-15-23;/h1-18,24H,19-20,32H2;1H