methyl 5-azanyl-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate

Systemtic Name: methyl 5-azanyl-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate Openeye Name: methyl 5-amino-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate CAS Name: 5-amino-2-[2-(4-phenyl-1-piperazinyl)ethylamino]benzoic acid methyl ester IUPAC Name: methyl 5-amino-2-[2-(4-phenylpiperazin-1-yl)ethylamino]benzoate Traditional Name: 5-amino-2-[2-(4-phenylpiperazino)ethylamino]benzoic acid methyl ester Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)N)NCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)N)NCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O2/c1-26-20(25)18-15-16(21)7-8-19(18)22-9-10-23-11-13-24(14-12-23)17-5-3-2-4-6-17/h2-8,15,22H,9-14,21H2,1H3