2-[1-[(4-carbamimidoylphenyl)methylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoate

Systemtic Name: 2-[1-[(4-carbamimidoylphenyl)methylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoate Openeye Name: 2-[1-[(4-carbamimidoylphenyl)methylamino]tetralin-2-yl]acetate CAS Name: 2-[1-[(4-carbamimidoylphenyl)methylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetate IUPAC Name: 2-[1-[(4-carbamimidoylphenyl)methylamino]-1,2,3,4-tetrahydronaphthalen-2-yl]acetate Traditional Name: 2-[1-[(4-amidinobenzyl)amino]tetralin-2-yl]acetate Formula: C20H22N3O2- MolecularWeight: 336.40758

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C(C1CC(=O)[O-])NCC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1CC2=CC=CC=C2C(C1CC(=O)[O-])NCC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C20H23N3O2/c21-20(22)15-7-5-13(6-8-15)12-23-19-16(11-18(24)25)10-9-14-3-1-2-4-17(14)19/h1-8,16,19,23H,9-12H2,(H3,21,22)(H,24,25)/p-1