propan-2-yl 2-[1-[1-(4-carbamimidoylphenyl)piperidin-4-yl]carbonylpiperidin-4-ylidene]ethanoate

Systemtic Name: propan-2-yl 2-[1-[1-(4-carbamimidoylphenyl)piperidin-4-yl]carbonylpiperidin-4-ylidene]ethanoate Openeye Name: isopropyl 2-[1-[1-(4-carbamimidoylphenyl)piperidine-4-carbonyl]-4-piperidylidene]acetate CAS Name: 2-[1-[[1-(4-carbamimidoylphenyl)-4-piperidinyl]-oxomethyl]-4-piperidinylidene]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-[1-(4-carbamimidoylphenyl)piperidine-4-carbonyl]piperidin-4-ylidene]acetate Traditional Name: 2-[1-[1-(4-amidinophenyl)isonipecotoyl]-4-piperidylidene]acetic acid isopropyl ester Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C=C1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)OC(=O)C=C1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H32N4O3/c1-16(2)30-21(28)15-17-7-11-27(12-8-17)23(29)19-9-13-26(14-10-19)20-5-3-18(4-6-20)22(24)25/h3-6,15-16,19H,7-14H2,1-2H3,(H3,24,25)