methyl 2-[7-[(4-carbamimidoylphenyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoate

Systemtic Name: methyl 2-[7-[(4-carbamimidoylphenyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]ethanoate Openeye Name: methyl 2-[7-[(4-carbamimidoylphenyl)carbamoyl]tetralin-2-yl]acetate CAS Name: 2-[7-[(4-carbamimidoylanilino)-oxomethyl]-1,2,3,4-tetrahydronaphthalen-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[7-[(4-carbamimidoylphenyl)carbamoyl]-1,2,3,4-tetrahydronaphthalen-2-yl]acetate Traditional Name: 2-[7-[(4-amidinophenyl)carbamoyl]tetralin-2-yl]acetic acid methyl ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCC2=C(C1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CC1CCC2=C(C1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

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