methyl 7-(dipropylamino)-8-oxidanyl-3-phenylmethoxy-naphthalene-2-carboxylate hydrochloride

Systemtic Name: methyl 7-(dipropylamino)-8-oxidanyl-3-phenylmethoxy-naphthalene-2-carboxylate hydrochloride Openeye Name: methyl 3-benzyloxy-7-(dipropylamino)-8-hydroxy-naphthalene-2-carboxylate hydrochloride CAS Name: 7-(dipropylamino)-8-hydroxy-3-phenylmethoxy-2-naphthalenecarboxylic acid methyl ester hydrochloride IUPAC Name: methyl 7-(dipropylamino)-8-hydroxy-3-phenylmethoxynaphthalene-2-carboxylate hydrochloride Traditional Name: 3-benzoxy-7-(dipropylamino)-8-hydroxy-naphthalene-2-carboxylic acid methyl ester hydrochloride Formula: C25H30ClNO4 MolecularWeight: 443.963

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C2=CC(=C(C=C2C=C1)OCC3=CC=CC=C3)C(=O)OC)O.Cl

Isomeric SMILES

CCCN(CCC)C1=C(C2=CC(=C(C=C2C=C1)OCC3=CC=CC=C3)C(=O)OC)O.Cl

InChI

InChI=1S/C25H29NO4.ClH/c1-4-13-26(14-5-2)22-12-11-19-15-23(30-17-18-9-7-6-8-10-18)21(25(28)29-3)16-20(19)24(22)27;/h6-12,15-16,27H,4-5,13-14,17H2,1-3H3;1H