2-[1-[(4-carbamimidoylphenyl)carbonyl-propyl-amino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[1-[(4-carbamimidoylphenyl)carbonyl-propyl-amino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[1-[(4-carbamimidoylbenzoyl)-propyl-amino]tetralin-2-yl]acetic acid CAS Name: 2-[1-[[(4-carbamimidoylphenyl)-oxomethyl]-propylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[1-[(4-carbamimidoylbenzoyl)-propylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[1-[(4-amidinobenzoyl)-propyl-amino]tetralin-2-yl]acetic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1C(CCC2=CC=CC=C12)CC(=O)O)C(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCCN(C1C(CCC2=CC=CC=C12)CC(=O)O)C(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H27N3O3/c1-2-13-26(23(29)17-10-8-16(9-11-17)22(24)25)21-18(14-20(27)28)12-7-15-5-3-4-6-19(15)21/h3-6,8-11,18,21H,2,7,12-14H2,1H3,(H3,24,25)(H,27,28)