(2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-(4-cyclopentyloxyphenyl)propanoic acid hydrochloride

Systemtic Name: (2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-(4-cyclopentyloxyphenyl)propanoic acid hydrochloride Openeye Name: (2S)-3-(7-carbamimidoyl-2-naphthyl)-2-[4-(cyclopentoxy)phenyl]propanoic acid hydrochloride CAS Name: (2S)-3-(7-carbamimidoyl-2-naphthalenyl)-2-(4-cyclopentyloxyphenyl)propanoic acid hydrochloride IUPAC Name: (2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-(4-cyclopentyloxyphenyl)propanoic acid hydrochloride Traditional Name: (2S)-3-(7-amidino-2-naphthyl)-2-[4-(cyclopentoxy)phenyl]propionic acid hydrochloride Formula: C25H27ClN2O3 MolecularWeight: 438.94648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=C(C=C2)C(CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N)C(=O)O.Cl

Isomeric SMILES

C1CCC(C1)OC2=CC=C(C=C2)[C@H](CC3=CC4=C(C=C3)C=CC(=C4)C(=N)N)C(=O)O.Cl

InChI

InChI=1S/C25H26N2O3.ClH/c26-24(27)19-8-7-17-6-5-16(13-20(17)15-19)14-23(25(28)29)18-9-11-22(12-10-18)30-21-3-1-2-4-21;/h5-13,15,21,23H,1-4,14H2,(H3,26,27)(H,28,29);1H/t23-;/m0./s1