propan-2-yl (2S)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate

Systemtic Name: propan-2-yl (2S)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate Openeye Name: isopropyl (2S)-3-(3-carbamimidoylphenyl)-2-(2-naphthylsulfonylamino)propanoate CAS Name: (2S)-3-(3-carbamimidoylphenyl)-2-(2-naphthalenylsulfonylamino)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-3-(3-carbamimidoylphenyl)-2-(naphthalen-2-ylsulfonylamino)propanoate Traditional Name: (2S)-3-(3-amidinophenyl)-2-(2-naphthylsulfonylamino)propionic acid isopropyl ester Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CC1=CC=CC(=C1)C(=N)N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)OC(=O)[C@H](CC1=CC=CC(=C1)C(=N)N)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C23H25N3O4S/c1-15(2)30-23(27)21(13-16-6-5-9-19(12-16)22(24)25)26-31(28,29)20-11-10-17-7-3-4-8-18(17)14-20/h3-12,14-15,21,26H,13H2,1-2H3,(H3,24,25)/t21-/m0/s1