2-[7-[(4-carbamimidoylphenyl)carbonyl-methyl-amino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid

Systemtic Name: 2-[7-[(4-carbamimidoylphenyl)carbonyl-methyl-amino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[7-[(4-carbamimidoylbenzoyl)-methyl-amino]tetralin-2-yl]acetic acid CAS Name: 2-[7-[[(4-carbamimidoylphenyl)-oxomethyl]-methylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[7-[(4-carbamimidoylbenzoyl)-methylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[7-[(4-amidinobenzoyl)-methyl-amino]tetralin-2-yl]acetic acid Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC2=C(CCC(C2)CC(=O)O)C=C1)C(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN(C1=CC2=C(CCC(C2)CC(=O)O)C=C1)C(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H23N3O3/c1-24(21(27)16-6-4-15(5-7-16)20(22)23)18-9-8-14-3-2-13(11-19(25)26)10-17(14)12-18/h4-9,12-13H,2-3,10-11H2,1H3,(H3,22,23)(H,25,26)