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

Systemtic Name: 2-[7-[(4-carbamimidoylphenyl)carbonyl-propyl-amino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[7-[(4-carbamimidoylbenzoyl)-propyl-amino]tetralin-2-yl]acetic acid CAS Name: 2-[7-[[(4-carbamimidoylphenyl)-oxomethyl]-propylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[7-[(4-carbamimidoylbenzoyl)-propylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[7-[(4-amidinobenzoyl)-propyl-amino]tetralin-2-yl]acetic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3/c1-2-11-26(23(29)18-7-5-17(6-8-18)22(24)25)20-10-9-16-4-3-15(13-21(27)28)12-19(16)14-20/h5-10,14-15H,2-4,11-13H2,1H3,(H3,24,25)(H,27,28)