[3-[[4-(1-adamantyl)phenyl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[4-(1-adamantyl)phenyl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[4-(1-adamantyl)anilino]-3-oxo-propyl]ammonium CAS Name: [3-[4-(1-adamantyl)anilino]-3-oxopropyl]ammonium IUPAC Name: [3-[4-(1-adamantyl)anilino]-3-oxopropyl]azanium Traditional Name: [3-[4-(1-adamantyl)anilino]-3-keto-propyl]ammonium Formula: C19H27N2O+ MolecularWeight: 299.43048

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)CC[NH3+]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)NC(=O)CC[NH3+]

InChI

InChI=1S/C19H26N2O/c20-6-5-18(22)21-17-3-1-16(2-4-17)19-10-13-7-14(11-19)9-15(8-13)12-19/h1-4,13-15H,5-12,20H2,(H,21,22)/p+1