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

Systemtic Name: 2-[7-[(4-carbamimidoylphenyl)carbamoyl]-1-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoic acid Openeye Name: 2-[7-[(4-carbamimidoylphenyl)carbamoyl]-1-ethyl-tetralin-2-yl]acetic acid CAS Name: 2-[7-[(4-carbamimidoylanilino)-oxomethyl]-1-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid IUPAC Name: 2-[7-[(4-carbamimidoylphenyl)carbamoyl]-1-ethyl-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid Traditional Name: 2-[7-[(4-amidinophenyl)carbamoyl]-1-ethyl-tetralin-2-yl]acetic acid Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CCC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)O

Isomeric SMILES

CCC1C(CCC2=C1C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N)CC(=O)O

InChI

InChI=1S/C22H25N3O3/c1-2-18-15(12-20(26)27)5-3-13-4-6-16(11-19(13)18)22(28)25-17-9-7-14(8-10-17)21(23)24/h4,6-11,15,18H,2-3,5,12H2,1H3,(H3,23,24)(H,25,28)(H,26,27)