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

Systemtic Name: propan-2-yl 2-[1-[4-(4-carbamimidoylphenyl)piperazin-1-yl]carbonylpiperidin-4-yl]ethanoate Openeye Name: isopropyl 2-[1-[4-(4-carbamimidoylphenyl)piperazine-1-carbonyl]-4-piperidyl]acetate CAS Name: 2-[1-[[4-(4-carbamimidoylphenyl)-1-piperazinyl]-oxomethyl]-4-piperidinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[1-[4-(4-carbamimidoylphenyl)piperazine-1-carbonyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[4-(4-amidinophenyl)piperazine-1-carbonyl]-4-piperidyl]acetic acid isopropyl ester Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC1CCN(CC1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)OC(=O)CC1CCN(CC1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C22H33N5O3/c1-16(2)30-20(28)15-17-7-9-26(10-8-17)22(29)27-13-11-25(12-14-27)19-5-3-18(4-6-19)21(23)24/h3-6,16-17H,7-15H2,1-2H3,(H3,23,24)