6-(3-azanylpropyl)-7-methoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione hydrochloride

Systemtic Name: 6-(3-azanylpropyl)-7-methoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione hydrochloride Openeye Name: 6-(3-aminopropyl)-7-methoxy-3-nitro-indeno[1,2-c]isoquinoline-5,11-dione hydrochloride CAS Name: 6-(3-aminopropyl)-7-methoxy-3-nitroindeno[1,2-c]isoquinoline-5,11-dione hydrochloride IUPAC Name: 6-(3-aminopropyl)-7-methoxy-3-nitroindeno[1,2-c]isoquinoline-5,11-dione hydrochloride Traditional Name: 6-(3-aminopropyl)-7-methoxy-3-nitro-inden[1,2-c]isoquinoline-5,11-quinone hydrochloride Formula: C20H18ClN3O5 MolecularWeight: 415.82702

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C3=C(C2=O)C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CCCN.Cl

Isomeric SMILES

COC1=CC=CC2=C1C3=C(C2=O)C4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CCCN.Cl

InChI

InChI=1S/C20H17N3O5.ClH/c1-28-15-5-2-4-13-16(15)18-17(19(13)24)12-7-6-11(23(26)27)10-14(12)20(25)22(18)9-3-8-21;/h2,4-7,10H,3,8-9,21H2,1H3;1H