2,6-dimethyl-5-nitro-4-[2-[5-(4-pyrazin-2-ylpiperazin-1-yl)pentoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-5-nitro-4-[2-[5-(4-pyrazin-2-ylpiperazin-1-yl)pentoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-5-nitro-4-[2-[5-(4-pyrazin-2-ylpiperazin-1-yl)pentoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-5-nitro-4-[2-[5-[4-(2-pyrazinyl)-1-piperazinyl]pentoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-5-nitro-4-[2-[5-(4-pyrazin-2-ylpiperazin-1-yl)pentoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-5-nitro-4-[2-[5-(4-pyrazin-2-ylpiperazino)pentoxy]phenyl]-1,4-dihydropyridine-3-carboxylic acid Formula: C27H34N6O5 MolecularWeight: 522.59606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2OCCCCCN3CCN(CC3)C4=NC=CN=C4)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CC=CC=C2OCCCCCN3CCN(CC3)C4=NC=CN=C4)C(=O)O

InChI

InChI=1S/C27H34N6O5/c1-19-24(27(34)35)25(26(33(36)37)20(2)30-19)21-8-4-5-9-22(21)38-17-7-3-6-12-31-13-15-32(16-14-31)23-18-28-10-11-29-23/h4-5,8-11,18,25,30H,3,6-7,12-17H2,1-2H3,(H,34,35)