[2-azanyl-3-[2-(methylamino)-2-oxidanylidene-ethyl]-4H-quinazolin-7-yl]oxy-cyclohexyl-heptanoyl-hexyl-azanium

Systemtic Name: [2-azanyl-3-[2-(methylamino)-2-oxidanylidene-ethyl]-4H-quinazolin-7-yl]oxy-cyclohexyl-heptanoyl-hexyl-azanium Openeye Name: [2-amino-3-[2-(methylamino)-2-oxo-ethyl]-4H-quinazolin-7-yl]oxy-cyclohexyl-heptanoyl-hexyl-ammonium CAS Name: [2-amino-3-[2-(methylamino)-2-oxoethyl]-4H-quinazolin-7-yl]oxy-cyclohexyl-hexyl-(1-oxoheptyl)ammonium IUPAC Name: [2-amino-3-[2-(methylamino)-2-oxoethyl]-4H-quinazolin-7-yl]oxy-cyclohexyl-heptanoyl-hexylazanium Traditional Name: [2-amino-3-[2-keto-2-(methylamino)ethyl]-4H-quinazolin-7-yl]oxy-cyclohexyl-enanthyl-hexyl-ammonium Formula: C30H50N5O3+ MolecularWeight: 528.7497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)[N+](CCCCCC)(C1CCCCC1)OC2=CC3=C(CN(C(=N3)N)CC(=O)NC)C=C2

Isomeric SMILES

CCCCCCC(=O)[N+](CCCCCC)(C1CCCCC1)OC2=CC3=C(CN(C(=N3)N)CC(=O)NC)C=C2

InChI

InChI=1S/C30H49N5O3/c1-4-6-8-13-17-29(37)35(20-14-9-7-5-2,25-15-11-10-12-16-25)38-26-19-18-24-22-34(23-28(36)32-3)30(31)33-27(24)21-26/h18-19,21,25H,4-17,20,22-23H2,1-3H3,(H2-,31,32,33,36)/p+1