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

Systemtic Name: 2-[7-[(4-carbamimidoylphenyl)-propyl-carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[7-[(4-carbamimidoylphenyl)-propyl-carbamoyl]tetralin-2-yl]acetic acid CAS Name: 2-[7-[(4-carbamimidoyl-N-propylanilino)-oxomethyl]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[7-[(4-carbamimidoylphenyl)-propylcarbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[7-[(4-amidinophenyl)-propyl-carbamoyl]tetralin-2-yl]acetic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=C(C=C1)C(=N)N)C(=O)C2=CC3=C(CCC(C3)CC(=O)O)C=C2

Isomeric SMILES

CCCN(C1=CC=C(C=C1)C(=N)N)C(=O)C2=CC3=C(CCC(C3)CC(=O)O)C=C2

InChI

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