1-[1-[2-nitro-4-(4-phenylpiperazin-1-yl)carbonyl-phenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-[2-nitro-4-(4-phenylpiperazin-1-yl)carbonyl-phenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[2-nitro-4-(4-phenylpiperazine-1-carbonyl)phenyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[2-nitro-4-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[2-nitro-4-(4-phenylpiperazine-1-carbonyl)phenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[2-nitro-4-(4-phenylpiperazine-1-carbonyl)phenyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C30H31N5O5 MolecularWeight: 541.59764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)N5CCN(CC5)C6=CC=CC=C6)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)N5CCN(CC5)C6=CC=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C30H31N5O5/c36-29(33-18-16-31(17-19-33)24-7-2-1-3-8-24)22-10-11-27(28(20-22)35(38)39)32-14-12-25(13-15-32)34-26-9-5-4-6-23(26)21-40-30(34)37/h1-11,20,25H,12-19,21H2